7-chloranyl-5-methylsulfonyl-N-(2-morpholin-4-ylethyl)-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide

Systemtic Name: 7-chloranyl-5-methylsulfonyl-N-(2-morpholin-4-ylethyl)-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Openeye Name: 7-chloro-5-methylsulfonyl-N-(2-morpholinoethyl)-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide CAS Name: 7-chloro-5-methylsulfonyl-N-[2-(4-morpholinyl)ethyl]-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide IUPAC Name: 7-chloro-5-methylsulfonyl-N-(2-morpholin-4-ylethyl)-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Traditional Name: 7-chloro-5-mesyl-N-(2-morpholinoethyl)-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Formula: C17H24ClN3O5S MolecularWeight: 417.90756

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(OC2=C1C=C(C=C2)Cl)C(=O)NCCN3CCOCC3

Isomeric SMILES

CS(=O)(=O)N1CCC(OC2=C1C=C(C=C2)Cl)C(=O)NCCN3CCOCC3

InChI

InChI=1S/C17H24ClN3O5S/c1-27(23,24)21-6-4-16(26-15-3-2-13(18)12-14(15)21)17(22)19-5-7-20-8-10-25-11-9-20/h2-3,12,16H,4-11H2,1H3,(H,19,22)